%chk=000015732.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000015732

0 1
 O   -3.415100      0.1872000      1.3000000E-03
 O    3.410900      0.1910000     -1.9000000E-03
 N   -3.672100       2.434100      8.9999998E-04
 N    3.665500       2.438300     -1.9999999E-04
 C   -1.400600       1.420500     -9.9999997E-05
 C    1.395100       1.422100     -1.2000001E-03
 C   -2.837300       1.419500      1.0000000E-03
 C    2.837600       1.422800     -1.5000000E-03
 C  -0.6967000      0.2129000     -1.0000000E-03
 C   0.6982000      0.2137000     -1.5000000E-03
 C  -0.6979000       2.628900      1.9999999E-04
 C   0.6970000       2.629800     -3.0000001E-04
 C   -4.743100      0.4687000      1.3000000E-03
 C    4.745000      0.4661000     -7.9999998E-04
 C   -5.630400     -0.6687000      9.9999997E-05
 C    5.627300     -0.6623000      3.0000001E-04
 C   -4.900900       1.825100      1.3000000E-03
 C    4.894900       1.830700       0.000000    
 C   -7.011900     -0.4747000     -1.3000000E-03
 C    7.014800     -0.4748000      2.9000000E-03
 C   -5.107900      -1.962000      1.2000001E-03
 C    5.112300      -1.964200     -1.9000000E-03
 C   -7.870600      -1.574000     -1.4000000E-03
 C    7.874600      -1.573100      3.0000000E-03
 C   -5.966700      -3.061200      1.0000000E-03
 C    5.972300      -3.062400     -1.7000000E-03
 C   -7.348000      -2.867100     -3.0000001E-04
 C    7.353500      -2.866700      6.9999998E-04
 H   -1.203000     -0.7492000     -1.2000001E-03
 H    1.205900     -0.7476000     -2.2000000E-03
 H   -1.220500       3.582600      1.0000000E-03
 H    1.219000       3.583600       0.000000    
 H   -5.812400       2.404400      1.1000000E-03
 H    5.806200       2.410700      1.2000001E-03
 H   -7.447000      0.5214000     -2.0999999E-03
 H    7.450200      0.5216000      4.6000001E-03
 H   -4.037700      -2.152400      2.4999999E-03
 H    4.042100      -2.156600     -4.1000000E-03
 H   -8.946200      -1.423300     -2.4000001E-03
 H    8.950000      -1.421200      4.9000001E-03
 H   -5.560300      -4.068500      1.9000000E-03
 H    5.567100      -4.070100     -3.5000001E-03
 H   -8.016600      -3.722900     -3.9999999E-04
 H    8.023000      -3.721900      7.9999998E-04


%chk=000015732-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000015732

0 1
O -3.584383 0.049065 -0.000141
O 3.585254 0.050639 0.000379
N -3.697842 2.337306 0.000154
N 3.697651 2.338849 0.000483
C -1.420422 1.252085 0.000170
C 1.420884 1.252507 0.000393
C -2.873474 1.281725 0.000054
C 2.873896 1.282489 0.000478
C -0.701586 0.023556 0.000069
C 0.702305 0.023780 0.000183
C -0.700491 2.482349 0.000393
C 0.700532 2.482546 0.000495
C -4.956928 0.412948 -0.000133
C 4.957991 0.415333 0.000394
C -5.957745 -0.646585 -0.000242
C 5.959003 -0.644134 0.000232
C -4.996110 1.806799 -0.000133
C 4.996191 1.809061 0.000690
C -7.343973 -0.318892 -0.000564
C 7.345093 -0.316055 0.000582
C -5.573939 -2.017328 -0.000045
C 5.575344 -2.014851 -0.000263
C -8.317092 -1.336605 -0.000664
C 8.318420 -1.333608 0.000414
C -6.553495 -3.030891 -0.000155
C 6.555127 -3.028222 -0.000414
C -7.928472 -2.698097 -0.000460
C 7.930043 -2.695167 -0.000085
H -1.253227 -0.921238 -0.000104
H 1.254225 -0.920868 0.000107
H -1.264171 3.420241 0.000479
H 1.263991 3.420579 0.000652
H -5.864225 2.459984 -0.000148
H 5.864003 2.462688 0.000804
H -7.657543 0.730961 -0.000752
H 7.658450 0.733851 0.000999
H -4.510040 -2.273661 0.000201
H 4.511510 -2.271397 -0.000529
H -9.379666 -1.070193 -0.000909
H 9.380953 -1.067009 0.000681
H -6.244970 -4.082054 -0.000002
H 6.246818 -4.079453 -0.000794
H -8.687544 -3.487651 -0.000546
H 8.689254 -3.484580 -0.000205


